About trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane
trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane (PubChem CID 10878326) has the molecular formula C13H22Si
and a molecular weight of 206.40 g/mol. Its IUPAC name is trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane.
Molecular Properties
| Compound Name | trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane |
| PubChem CID | 10878326 |
| Molecular Formula | C13H22Si |
| Molecular Weight | 206.40 g/mol |
| Exact Mass | 206.15 |
| IUPAC Name | trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane |
| SMILES | C=C(C#C[Si](C)(C)C)CCC=C(C)C |
| InChI | InChI=1S/C13H22Si/c1-12(2)8-7-9-13(3)10-11-14(4,5)6/h8H,3,7,9H2,1-2,4-6H3 |
| InChIKey | KGYBCTWTOUUBNU-UHFFFAOYSA-N |
| XLogP | 4.17 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 3 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 206.40 |
| LogP ≤ 5 | 4.17 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane?
The IUPAC name of trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane (CID 10878326) is trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane.
What is the SMILES notation for trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane?
The canonical SMILES for trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane is C=C(C#C[Si](C)(C)C)CCC=C(C)C.
What is the InChIKey of trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane?
The InChIKey is KGYBCTWTOUUBNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22Si/c1-12(2)8-7-9-13(3)10-11-14(4,5)6/h8H,3,7,9H2,1-2,4-6H3.
What are the key properties of trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane?
trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane has a molecular weight of 206.40 g/mol, XLogP of 4.17, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(7-methyl-3-methylideneoct-6-en-1-ynyl)silane is sourced from PubChem (CID 10878326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).